N-ethyl-2-methyl-2-propyl-3H-thiophen-3-amine

C10H19NS — CID 57262193

IUPACN-ethyl-2-methyl-2-propyl-3H-thiophen-3-amine
SMILESCCCC1(C)SC=CC1NCC
InChIInChI=1S/C10H19NS/c1-4-7-10(3)9(11-5-2)6-8-12-10/h6,8-9,11H,4-5,7H2,1-3H3
InChIKeyIRYINMIIDKGWKA-UHFFFAOYSA-N
MW185.34 g/mol
LogP2.78
Rot. Bonds4

About N-ethyl-2-methyl-2-propyl-3H-thiophen-3-amine

N-ethyl-2-methyl-2-propyl-3H-thiophen-3-amine (PubChem CID 57262193) has the molecular formula C10H19NS and a molecular weight of 185.34 g/mol. Its IUPAC name is N-ethyl-2-methyl-2-propyl-3H-thiophen-3-amine.

Molecular Properties

Compound NameN-ethyl-2-methyl-2-propyl-3H-thiophen-3-amine
PubChem CID57262193
Molecular FormulaC10H19NS
Molecular Weight185.34 g/mol
Exact Mass185.12
IUPAC NameN-ethyl-2-methyl-2-propyl-3H-thiophen-3-amine
SMILESCCCC1(C)SC=CC1NCC
InChIInChI=1S/C10H19NS/c1-4-7-10(3)9(11-5-2)6-8-12-10/h6,8-9,11H,4-5,7H2,1-3H3
InChIKeyIRYINMIIDKGWKA-UHFFFAOYSA-N
XLogP2.78
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.34
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-Methyl-3a,4,5,6,7,7a-hexahydrothieno[3,2-c]pyridine
CID 44447164
N-ethyl-2-propyl-2,3-dihydrothiophen-3-amine
CID 54101904
N,2-dipropyl-2,3-dihydrothiophen-3-amine
CID 54478450
N-ethyl-5-prop-2-enylthiolan-3-amine
CID 57017771
2-methyl-N,2-dipropyl-3H-thiophen-3-amine
CID 57027759
N-(2-methyl-2-propyl-3H-thiophen-3-yl)acetamide
CID 57068739
N-[(2-methyl-3H-thiophen-2-yl)methyl]propan-2-amine
CID 57284310
2-Pentyl-5,5-bis(prop-2-enyl)-1,3-thiazolidine
CID 69921126
(3S)-N,5-dimethyl-4-methylidene-1-methylsulfanylhexan-3-amine
CID 88936056
(3S)-N-ethyl-4-methylidene-1-methylsulfanylheptan-3-amine
CID 89354545
(3S)-2-methyl-5-methylsulfanyl-N-pentylpent-1-en-3-amine
CID 89733499
(3S)-N-ethyl-4-methylidene-1-methylsulfanylhexan-3-amine
CID 89976814

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methyl-2-propyl-3H-thiophen-3-amine?
The IUPAC name of N-ethyl-2-methyl-2-propyl-3H-thiophen-3-amine (CID 57262193) is N-ethyl-2-methyl-2-propyl-3H-thiophen-3-amine.
What is the SMILES notation for N-ethyl-2-methyl-2-propyl-3H-thiophen-3-amine?
The canonical SMILES for N-ethyl-2-methyl-2-propyl-3H-thiophen-3-amine is CCCC1(C)SC=CC1NCC.
What is the InChIKey of N-ethyl-2-methyl-2-propyl-3H-thiophen-3-amine?
The InChIKey is IRYINMIIDKGWKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NS/c1-4-7-10(3)9(11-5-2)6-8-12-10/h6,8-9,11H,4-5,7H2,1-3H3.
What are the key properties of N-ethyl-2-methyl-2-propyl-3H-thiophen-3-amine?
N-ethyl-2-methyl-2-propyl-3H-thiophen-3-amine has a molecular weight of 185.34 g/mol, XLogP of 2.78, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methyl-2-propyl-3H-thiophen-3-amine is sourced from PubChem (CID 57262193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).